N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine

C12H23N3 — CID 59366714

IUPACN,N,5-tri(propan-2-yl)-1H-imidazol-2-amine
SMILESCC(C)c1cnc(N(C(C)C)C(C)C)[nH]1
InChIInChI=1S/C12H23N3/c1-8(2)11-7-13-12(14-11)15(9(3)4)10(5)6/h7-10H,1-6H3,(H,13,14)
InChIKeyXIDOWYLEZNYOGN-UHFFFAOYSA-N
MW209.34 g/mol
LogP3.16
Rot. Bonds4

About N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine

N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine (PubChem CID 59366714) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine.

Molecular Properties

Compound NameN,N,5-tri(propan-2-yl)-1H-imidazol-2-amine
PubChem CID59366714
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC NameN,N,5-tri(propan-2-yl)-1H-imidazol-2-amine
SMILESCC(C)c1cnc(N(C(C)C)C(C)C)[nH]1
InChIInChI=1S/C12H23N3/c1-8(2)11-7-13-12(14-11)15(9(3)4)10(5)6/h7-10H,1-6H3,(H,13,14)
InChIKeyXIDOWYLEZNYOGN-UHFFFAOYSA-N
XLogP3.16
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine?
The IUPAC name of N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine (CID 59366714) is N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine.
What is the SMILES notation for N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine?
The canonical SMILES for N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine is CC(C)c1cnc(N(C(C)C)C(C)C)[nH]1.
What is the InChIKey of N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine?
The InChIKey is XIDOWYLEZNYOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-8(2)11-7-13-12(14-11)15(9(3)4)10(5)6/h7-10H,1-6H3,(H,13,14).
What are the key properties of N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine?
N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine has a molecular weight of 209.34 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5-tri(propan-2-yl)-1H-imidazol-2-amine is sourced from PubChem (CID 59366714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).